N'-cyclohexyl-4-propan-2-ylpiperidine-1-carboximidamide

C15H29N3 — CID 14853590

IUPACN'-cyclohexyl-4-propan-2-ylpiperidine-1-carboximidamide
SMILESCC(C)C1CCN(/C(N)=N/C2CCCCC2)CC1
InChIInChI=1S/C15H29N3/c1-12(2)13-8-10-18(11-9-13)15(16)17-14-6-4-3-5-7-14/h12-14H,3-11H2,1-2H3,(H2,16,17)
InChIKeyYMCVXPYBFDBFRW-UHFFFAOYSA-N
MW251.42 g/mol
LogP3.00
Rot. Bonds2

About N'-cyclohexyl-4-propan-2-ylpiperidine-1-carboximidamide

N'-cyclohexyl-4-propan-2-ylpiperidine-1-carboximidamide (PubChem CID 14853590) has the molecular formula C15H29N3 and a molecular weight of 251.42 g/mol. Its IUPAC name is N'-cyclohexyl-4-propan-2-ylpiperidine-1-carboximidamide.

Molecular Properties

Compound NameN'-cyclohexyl-4-propan-2-ylpiperidine-1-carboximidamide
PubChem CID14853590
Molecular FormulaC15H29N3
Molecular Weight251.42 g/mol
Exact Mass251.24
IUPAC NameN'-cyclohexyl-4-propan-2-ylpiperidine-1-carboximidamide
SMILESCC(C)C1CCN(/C(N)=N/C2CCCCC2)CC1
InChIInChI=1S/C15H29N3/c1-12(2)13-8-10-18(11-9-13)15(16)17-14-6-4-3-5-7-14/h12-14H,3-11H2,1-2H3,(H2,16,17)
InChIKeyYMCVXPYBFDBFRW-UHFFFAOYSA-N
XLogP3.00
TPSA41.62 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.42
LogP ≤ 53.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

Analyze N'-cyclohexyl-4-propan-2-ylpiperidine-1-carboximidamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N'-cyclohexyl-4-propan-2-ylpiperidine-1-carboximidamide?
The IUPAC name of N'-cyclohexyl-4-propan-2-ylpiperidine-1-carboximidamide (CID 14853590) is N'-cyclohexyl-4-propan-2-ylpiperidine-1-carboximidamide.
What is the SMILES notation for N'-cyclohexyl-4-propan-2-ylpiperidine-1-carboximidamide?
The canonical SMILES for N'-cyclohexyl-4-propan-2-ylpiperidine-1-carboximidamide is CC(C)C1CCN(/C(N)=N/C2CCCCC2)CC1.
What is the InChIKey of N'-cyclohexyl-4-propan-2-ylpiperidine-1-carboximidamide?
The InChIKey is YMCVXPYBFDBFRW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29N3/c1-12(2)13-8-10-18(11-9-13)15(16)17-14-6-4-3-5-7-14/h12-14H,3-11H2,1-2H3,(H2,16,17).
What are the key properties of N'-cyclohexyl-4-propan-2-ylpiperidine-1-carboximidamide?
N'-cyclohexyl-4-propan-2-ylpiperidine-1-carboximidamide has a molecular weight of 251.42 g/mol, XLogP of 3.00, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N'-cyclohexyl-4-propan-2-ylpiperidine-1-carboximidamide is sourced from PubChem (CID 14853590), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).